Vitas-M small molecule compound

N-[(4-nitrophenyl)carbamothioyl]-4-(propan-2-yloxy)benzamide

Catalog ID
STK011944
SMILES CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)[N+](=O)[O-])C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-11(2)24-15-9-3-12(4-10-15)16(21)19-17(25)18-13-5-7-14(8-6-13)20(22)23/h3-11H,1-2H3,(H2,18,19,21,25)
InChIKey
WMSFLBNITRTYDQ-UHFFFAOYSA-N
Synonyms

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)(N+)(=O)(O)
CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC17H17N3O4Sc111(2)24159312(41015)16(21)1917(25)18135714(8613)20(22)23h311H12H3(H218192125)
MFCD02627015
N((4NITROPHENYL)CARBAMOTHIOYL)4(PROPAN2YLOXY)BENZAMIDE
N((4NITROPHENYL)CARBAMOTHIOYL)4PROPAN2YLOXYBENZAMIDE
STK011944
ZINC000004551429
ZINC04551429
ZINC4551429

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.